6-(azepan-1-ylsulfonyl)-N-(furan-2-ylmethyl)-4-oxidanylidene-1-prop-2-enyl-quinoline-3-carboxamide

Systemtic Name: 6-(azepan-1-ylsulfonyl)-N-(furan-2-ylmethyl)-4-oxidanylidene-1-prop-2-enyl-quinoline-3-carboxamide Openeye Name: 1-allyl-6-(azepan-1-ylsulfonyl)-N-(2-furylmethyl)-4-oxo-quinoline-3-carboxamide CAS Name: 6-(1-azepanylsulfonyl)-N-(2-furanylmethyl)-4-oxo-1-prop-2-enyl-3-quinolinecarboxamide IUPAC Name: 6-(azepan-1-ylsulfonyl)-N-(furan-2-ylmethyl)-4-oxo-1-prop-2-enylquinoline-3-carboxamide Traditional Name: 1-allyl-6-(azepan-1-ylsulfonyl)-N-(2-furfuryl)-4-keto-quinoline-3-carboxamide Formula: C24H27N3O5S MolecularWeight: 469.55328

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N3CCCCCC3)C(=O)NCC4=CC=CO4

Isomeric SMILES

C=CCN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N3CCCCCC3)C(=O)NCC4=CC=CO4

InChI

InChI=1S/C24H27N3O5S/c1-2-11-26-17-21(24(29)25-16-18-8-7-14-32-18)23(28)20-15-19(9-10-22(20)26)33(30,31)27-12-5-3-4-6-13-27/h2,7-10,14-15,17H,1,3-6,11-13,16H2,(H,25,29)